Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | SLC5A2 | P31639 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14626066 | 1.00 | CYP3A4 (0.42) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL16808485 | 1.00 | CYP3A4 (0.42) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL18801954 | 1.00 | CYP3A4 (0.42) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL17093240 | 0.86 | CYP3A4 (0.40) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL17093290 | 0.86 | CYP3A4 (0.40) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL16808524 | 0.86 | CYP3A4 (0.40) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL18802267 | 0.86 | CYP3A4 (0.40) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL18176800 | 0.83 | CYP3A4 (0.39) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL18176799 | 0.83 | CYP3A4 (0.39) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 | |
| SCHEMBL17827377 | 0.83 | CYP3A4 (0.39) | CYP3A4MAPK1HCRTR2HCRTR1ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007005935-A2 | NOREPINEPHRINE TRANSPORTER RADIOTRACERS AND METHODS OF SYNTHESES THEREOF | MOLECULAR NEUROIMAGING, LLC (US) | 2007-01-11 | — | — | WO | disclosed |
| WO-2007005935-A2 | NOREPINEPHRINE TRANSPORTER RADIOTRACERS AND METHODS OF SYNTHESES THEREOF | MOLECULAR NEUROIMAGING, LLC (US) | 2007-01-11 | — | — | WO | disclosed |